V013-7337 Screening compound: N-({benzyl[(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-cyclopropyl-2-phenylbutanamide

V013-7337 Screening compound: N-({benzyl[(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-cyclopropyl-2-phenylbutanamide
V013-7337 Screening compound: N-({benzyl[(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-cyclopropyl-2-phenylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V013-7337
N-({benzyl[(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-cyclopropyl-2-phenylbutanamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V013-7337

Molecular Formula

C28H32N2O2S (C28 H32 N2 O2 S)

Compound Name

N-({benzyl[(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-cyclopropyl-2-phenylbutanamide

IUPAC name

N-({benzyl[(3-methylthiophen-2-yl)methyl]carbamoyl}methyl)-N-cyclopropyl-2-phenylbutanamide

SMILES

CCC(C(N(CC(N(Cc1c(C)ccs1)Cc1ccccc1)=O)C1CC1)=O)c1ccccc1

InChI

InChI=1S/C28H32N2O2S/c1-3-25(23-12-8-5-9-13-23)28(32)30(24-14-15-24)20-27(31)29(18-22-10-6-4-7-11-22)19-26-21(2)16-17-33-26/h4-13,16-17,24-25H,3,14-15,18-20H2,1-2H3/t25-/m1/s1

InChI Key

YVYZVRFWRJZFRM-RUZDIDTESA-N

MDL Number (MFCD)

MFCD19746191

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

460.64

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.629

Distribution Coefficient, logD

5.629

Water Solubility, LogSw

-5.37

Polar Surface Area

32.456

Acid Dissociation Constant (pKa)

18.74

Base Dissociation Constant (pKb)

-2.02

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

References: we are preparing a list of scientific research reports with V013-7337 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V013-7337?
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What is the minimum amount of V013-7337 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V013-7337
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V013-7337
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V013-7337 available by request